1-[4-(6-ethoxy-1,3-benzothiazol-2-yl)phenyl]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[4-(6-ethoxy-1,3-benzothiazol-2-yl)phenyl]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[4-(6-ethoxy-1,3-benzothiazol-2-yl)phenyl]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[4-(6-ethoxy-1,3-benzothiazol-2-yl)phenyl]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[4-(6-ethoxy-1,3-benzothiazol-2-yl)phenyl]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[4-(6-ethoxy-1,3-benzothiazol-2-yl)phenyl]-3-(tetrahydrofurfuryl)thiourea Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NCC4CCCO4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NCC4CCCO4

InChI

InChI=1S/C21H23N3O2S2/c1-2-25-16-9-10-18-19(12-16)28-20(24-18)14-5-7-15(8-6-14)23-21(27)22-13-17-4-3-11-26-17/h5-10,12,17H,2-4,11,13H2,1H3,(H2,22,23,27)