3-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylazepan-2-one

Systemtic Name: 3-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylazepan-2-one Openeye Name: 3-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylazepan-2-one CAS Name: 3-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]-2-azepanone IUPAC Name: 3-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylazepan-2-one Traditional Name: 3-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]azepan-2-one Formula: C18H17N3OS2 MolecularWeight: 355.47708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)SC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1CCNC(=O)C(C1)SC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C18H17N3OS2/c22-16-14(8-4-5-9-19-16)23-17-13-10-15(12-6-2-1-3-7-12)24-18(13)21-11-20-17/h1-3,6-7,10-11,14H,4-5,8-9H2,(H,19,22)