1-[[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-ethyl-thiourea

Systemtic Name: 1-[[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-ethyl-thiourea Openeye Name: 1-[[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-ethyl-thiourea CAS Name: 1-[[1-(3-bromophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-ethylthiourea IUPAC Name: 1-[[1-(3-bromophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-ethylthiourea Traditional Name: 1-[[1-(3-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-ethyl-thiourea Formula: C16H19BrN4S MolecularWeight: 379.31786

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(N(C(=C1)C)C2=CC(=CC=C2)Br)C

Isomeric SMILES

CCNC(=S)NN=CC1=C(N(C(=C1)C)C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C16H19BrN4S/c1-4-18-16(22)20-19-10-13-8-11(2)21(12(13)3)15-7-5-6-14(17)9-15/h5-10H,4H2,1-3H3,(H2,18,20,22)