1-acridin-9-yl-3-[3-[4-[3-(acridin-9-ylcarbamothioylamino)propyl]piperazin-1-yl]propyl]thiourea

Systemtic Name: 1-acridin-9-yl-3-[3-[4-[3-(acridin-9-ylcarbamothioylamino)propyl]piperazin-1-yl]propyl]thiourea Openeye Name: 1-acridin-9-yl-3-[3-[4-[3-(acridin-9-ylcarbamothioylamino)propyl]piperazin-1-yl]propyl]thiourea CAS Name: 1-(9-acridinyl)-3-[3-[4-[3-[[(9-acridinylamino)-sulfanylidenemethyl]amino]propyl]-1-piperazinyl]propyl]thiourea IUPAC Name: 1-acridin-9-yl-3-[3-[4-[3-(acridin-9-ylcarbamothioylamino)propyl]piperazin-1-yl]propyl]thiourea Traditional Name: 1-acridin-9-yl-3-[3-[4-[3-(acridin-9-ylthiocarbamoylamino)propyl]piperazino]propyl]thiourea Formula: C38H40N8S2 MolecularWeight: 672.9078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=S)NC2=C3C=CC=CC3=NC4=CC=CC=C42)CCCNC(=S)NC5=C6C=CC=CC6=NC7=CC=CC=C75

Isomeric SMILES

C1CN(CCN1CCCNC(=S)NC2=C3C=CC=CC3=NC4=CC=CC=C42)CCCNC(=S)NC5=C6C=CC=CC6=NC7=CC=CC=C75

InChI

InChI=1S/C38H40N8S2/c47-37(43-35-27-11-1-5-15-31(27)41-32-16-6-2-12-28(32)35)39-19-9-21-45-23-25-46(26-24-45)22-10-20-40-38(48)44-36-29-13-3-7-17-33(29)42-34-18-8-4-14-30(34)36/h1-8,11-18H,9-10,19-26H2,(H2,39,41,43,47)(H2,40,42,44,48)